1-[1-(3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)ethylamino]thiourea

Systemtic Name: 1-[1-(3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)ethylamino]thiourea Openeye Name: [1-(3-methyl-5-oxo-1-phenyl-pyrazol-4-ylidene)ethylamino]thiourea CAS Name: [1-(3-methyl-5-oxo-1-phenyl-4-pyrazolylidene)ethylamino]thiourea IUPAC Name: [1-(3-methyl-5-oxo-1-phenylpyrazol-4-ylidene)ethylamino]thiourea Traditional Name: [1-(5-keto-3-methyl-1-phenyl-2-pyrazolin-4-ylidene)ethylamino]thiourea Formula: C13H15N5OS MolecularWeight: 289.3561

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=C(C)NNC(=S)N)C2=CC=CC=C2

Isomeric SMILES

CC1=NN(C(=O)C1=C(C)NNC(=S)N)C2=CC=CC=C2

InChI

InChI=1S/C13H15N5OS/c1-8(15-16-13(14)20)11-9(2)17-18(12(11)19)10-6-4-3-5-7-10/h3-7,15H,1-2H3,(H3,14,16,20)